SCHEMBL8484355

SCHEMBL8484355

COc1cc(O)c(C(=O)c2ccc(OC)c(OC)c2OC)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.54
TUBB1 Q9H4B7 4/20 0.51
MAPT P10636 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
HMGCR P04035 1/20 0.50
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
LMNA P02545 2/20 0.49
CYP3A4 P08684 2/20 0.49
RECQL P46063 1/20 0.49
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
MCL1 Q07820 2/20 0.47
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9726919 0.86 MAPT (0.58) TUBB1MAPTTDP1NPC1RAB9A
SCHEMBL30374830 0.86 NPC1 (0.56) TUBB1MAPTTDP1HPGDLMNA
SCHEMBL5709936 0.86 NPC1 (0.56) TUBB1MAPTTDP1HPGDLMNA
SCHEMBL7367549 0.85 MAPT (0.50) TUBB1MAPTTDP1KDM4EHSD17B10
SCHEMBL7336340 0.81 LMNA (0.58) HTTTUBB1MAPTTDP1KDM4E
SCHEMBL10589919 0.78 KMT2A (0.50) HTTMAPTTDP1KDM4EHPGD
SCHEMBL8484707 0.77 MAPT (0.63) HTTTUBB1MAPTTDP1KDM4E
SCHEMBL7340588 0.77 LMNA (0.59) HTTMAPTHMGCRKDM4EHPGD
SCHEMBL4823325 0.77 TUBB1 (0.59) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27713896 0.75 MAPT (0.76) TUBB1MAPTTDP1KDM4EHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5981774-A PREPARING 3,5-DI(2,3-EPOXYPROPOXY)-1-HYDROXYXANTHONE BY REACTING 1,3,5-TRIMETHOXYXANTHONE WITH HYDROGEN IODIDE IN PHENOL WHEREBY 1,3,5-TRIHYDROXYXANTHONE IS OBTAINED, REACTING PRODUCT WITH EPICHLOROHYDRIN IN POTASSIUM HYDROXIDE NATIONAL SCIENCE COUNCIL (TW) 1999-11-09 US disclosed
US-5741813-A ADMINISTERING SUBSTITUTED XANTHONES NATIONAL SCIENCE COUNCIL (TW) 1998-04-21 US disclosed